%chk=000145493.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145493

0 1
 O   -2.927100      -2.934000      0.1084000    
 O  -0.9223000      -2.106600     -0.2583000    
 N   -2.160100      -1.971600     -0.1238000    
 N  -0.2898000      0.8692000       2.748100    
 C    1.907000      0.2968000      3.9700001E-02
 C    2.674000       1.406400     -0.2757000    
 C    2.466100     -0.9693000      0.1125000    
 C    3.829000      -1.129400     -0.1372000    
 C   0.4621000      0.4333000      0.3084000    
 C    4.036900       1.246200     -0.5255000    
 C    4.614400     -2.1700000E-02 -0.4563000    
 C   -1.920600      0.4462000     -0.4999000    
 C  -0.4755000      0.3334000     -0.6645000    
 C    2.088300       2.779200     -0.3614000    
 C   -2.719500     -0.6675000     -0.2409000    
 C    4.446800      -2.484900     -6.3699998E-02
 C   -2.500200       1.710200     -0.6096000    
 C   -4.098300     -0.5173000     -9.2000000E-02
 C   -3.878900       1.860500     -0.4606000    
 C   -4.677900      0.7467000     -0.2020000    
 C   4.5600001E-02  0.6741000       1.654400    
 H    1.859200      -1.835200      0.3654000    
 H    4.664200       2.097800     -0.7755000    
 H    5.677700     -0.1331000     -0.6514000    
 H  -0.1578000      0.1607000      -1.692400    
 H    1.315600       2.823300      -1.135800    
 H    1.659600       3.078800      0.6004000    
 H    2.845300       3.527500     -0.6214000    
 H    3.739800      -3.257300     -0.3850000    
 H    5.321100      -2.558800     -0.7193000    
 H    4.760200      -2.699500      0.9628000    
 H   -1.892800       2.589400     -0.8118000    
 H   -4.757100      -1.357900      0.1102000    
 H   -4.330400       2.844500     -0.5462000    
 H   -5.751400      0.8644000     -8.6300001E-02


%chk=000145493-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145493

0 1
O -3.081876 -3.275616 -0.716445
O -1.017463 -2.520753 -0.136114
N -2.267695 -2.320589 -0.412118
N -0.108849 2.733377 1.986473
C 1.941865 0.599460 -0.008276
C 2.908225 1.632635 -0.211447
C 2.352501 -0.764183 0.006362
C 3.700368 -1.143380 -0.179559
C 0.484285 0.884941 0.197691
C 4.258011 1.240831 -0.396876
C 4.653751 -0.111970 -0.379938
C -1.942131 0.203497 -0.284224
C -0.477265 0.111117 -0.420203
C 2.543221 3.106434 -0.270583
C -2.806053 -0.937011 -0.354525
C 4.118700 -2.602963 -0.154517
C -2.585542 1.470214 -0.170817
C -4.214855 -0.824703 -0.322762
C -3.987014 1.592810 -0.120547
C -4.809731 0.443676 -0.201432
C 0.138242 1.896628 1.166074
H 1.601245 -1.539266 0.199291
H 5.011106 2.019854 -0.565338
H 5.710316 -0.370330 -0.523054
H -0.099214 -0.669893 -1.086997
H 1.650291 3.287657 -0.896136
H 2.320428 3.515057 0.732399
H 3.376133 3.693829 -0.693029
H 3.254996 -3.268632 0.010646
H 4.595331 -2.900091 -1.107461
H 4.852751 -2.796605 0.650263
H -1.970259 2.373275 -0.147748
H -4.813766 -1.736936 -0.380449
H -4.437353 2.586418 -0.028360
H -5.899500 0.535711 -0.166447


